N-[(3-chloro-4-fluorophenyl)methyl]-1-[4-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(3-chloro-4-fluorophenyl)methyl]-1-[4-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
N-[(3-chloro-4-fluorophenyl)methyl]-1-[4-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | P257-0328 |
| Compound Name: | N-[(3-chloro-4-fluorophenyl)methyl]-1-[4-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide |
| Molecular Weight: | 417.91 |
| Molecular Formula: | C21 H25 Cl F N5 O |
| Smiles: | C1CCN(C1)c1c(cncn1)N1CCC(CC1)C(NCc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0613 |
| logD: | 2.9886 |
| logSw: | -3.3315 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.835 |
| InChI Key: | HVCLWLYUJNPKGD-UHFFFAOYSA-N |